| SpectraBase Compound ID | 5nicp5axVte |
|---|---|
| InChI | InChI=1S/C23H16ClFO5S/c1-14-20-10-9-18(30-31(27,28)19-4-2-3-16(24)12-19)13-22(20)29-23(26)21(14)11-15-5-7-17(25)8-6-15/h2-10,12-13H,11H2,1H3 |
| InChIKey | GTDBXIBKBSWOTN-UHFFFAOYSA-N |
| Mol Weight | 458.89 g/mol |
| Molecular Formula | C23H16ClFO5S |
| Exact Mass | 458.039101 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LdNWKNclFn |
|---|---|
| Name | 3-(p-fluorobenzyl)-7-hydroxy-4-methylcoumarin, m-chlorobenzenesulfonate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H16ClFO5S |
| InChI | InChI=1S/C23H16ClFO5S/c1-14-20-10-9-18(30-31(27,28)19-4-2-3-16(24)12-19)13-22(20)29-23(26)21(14)11-15-5-7-17(25)8-6-15/h2-10,12-13H,11H2,1H3 |
| InChIKey | GTDBXIBKBSWOTN-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56729M |
| Solvent | CDCl3 |